Introduction：Basic information about CAS 156629-59-3|4-[(4-CHLOROPHENYL)SULFANYL]-3-NITROBENZENECARBOXYLIC ACID, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 4-[(4-CHLOROPHENYL)SULFANYL]-3-NITROBENZENECARBOXYLIC ACID |
|---|
| CAS Number | 156629-59-3 | Molecular Weight | 309.72500 |
|---|
| Density | 1.56g/cm3 | Boiling Point | 487.9ºC at 760 mmHg |
|---|
| Molecular Formula | C13H8ClNO4S | Melting Point | 217ºC |
|---|
| MSDS | / | Flash Point | 248.9ºC |
|---|
Names
| Name | 4-(4-chlorophenyl)sulfanyl-3-nitrobenzoic acid |
|---|
| Synonym | More Synonyms |
|---|
Chemical & Physical Properties
| Density | 1.56g/cm3 |
|---|
| Boiling Point | 487.9ºC at 760 mmHg |
|---|
| Melting Point | 217ºC |
|---|
| Molecular Formula | C13H8ClNO4S |
|---|
| Molecular Weight | 309.72500 |
|---|
| Flash Point | 248.9ºC |
|---|
| Exact Mass | 308.98600 |
|---|
| PSA | 108.42000 |
|---|
| LogP | 4.62080 |
|---|
| Vapour Pressure | 2.47E-10mmHg at 25°C |
|---|
| Index of Refraction | 1.702 |
|---|
| InChIKey | YXJBPPSCOPYQHY-UHFFFAOYSA-N |
|---|
| SMILES | O=C(O)c1ccc(Sc2ccc(Cl)cc2)c([N+](=O)[O-])c1 |
|---|
Synonyms
| HMS545F16 |
| 4-(4-chlorophenylthio)-3-nitrobenzoic acid |
| 4-[(4-chlorophenyl)sulfanyl]-3-nitrobenzenecarboxylic acid |
